Home Other Building Blocks 2-[(2-methylphenyl)methyl]butanedioic acid

2-[(2-methylphenyl)methyl]butanedioic acid

CAS No.:
19263-11-7
Catalog Number:
AG01DZ7N
Molecular Formula:
Molecular Weight:
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01DZ7N
Chemical Name:
2-[(2-methylphenyl)methyl]butanedioic acid
CAS Number:
19263-11-7
MDL Number:
MFCD01029363
IUPAC Name:
2-[(2-methylphenyl)methyl]butanedioic acid
InChI:
InChI=1S/C12H14O4/c1-8-4-2-3-5-9(8)6-10(12(15)16)7-11(13)14/h2-5,10H,6-7H2,1H3,(H,13,14)(H,15,16)
InChI Key:
WFWVINOHIVDSEV-UHFFFAOYSA-N
NSC Number:
126994
Properties
Complexity:
262  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.089g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
222.24g/mol
Monoisotopic Mass:
222.089g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Literature
Title Journal
Metabolic biomarkers for monitoring in situ anaerobic hydrocarbon degradation. Environmental health perspectives 20050101
Properties